HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 166325Generated: October 28, 2026
2-(Ethyl(4-((2-cyano-5-chlorophenyl)azo)-3-methylphenyl)amino)-N,N,N-trimethylethanaminium hydrogen sulfate
https://huagongshe.com/en/chemical/166325
Identifiers & Physical Properties
| CAS No. | 72828-96-7 |
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| Molecular formula | C21H27ClN5O4S- |
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| Average molar mass | 481 g/mol |
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| Monoisotopic mass | 480.1472282 g/mol |
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| SMILES | CCN(CC[N+](C)(C)C)c1ccc(N=Nc2cc(Cl)ccc2C#N)c(C)c1.O=S(=O)([O-])[O-] |
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| InChIKey | ZENVJICDUGVOQK-UHFFFAOYSA-L |
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| PubChem CID | 166325 |
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Chemical & Physical Properties
| Topological polar surface area | 140 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 8 |
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| Rotatable bonds | 7 |
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| Heavy atoms | 32 |
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| Formal charge | -1 |
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| Complexity | 597 |
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